<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">287753</id>
  <title nil="true"/>
  <common-name>Spiro[1,3-benzodioxole-2,1'-cyclopentane]-4-yl n-methylcarbamate</common-name>
  <description>Spiro[1,3-benzodioxole-2,1'-cyclopentane]-4-yl n-methylcarbamate belongs to the benzodioxoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C13H15NO4 and an average molecular weight of 249.26 g/mol.</description>
  <cas>22781-25-5</cas>
  <pubchem-id>211255</pubchem-id>
  <chemical-formula>C13H15NO4</chemical-formula>
  <weight>249.26</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-28T00:18:36Z</created-at>
  <updated-at type="dateTime">2026-08-28T00:18:36Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CNC(=O)OC1=CC=CC2=C1OC3(O2)CCCC3</moldb-smiles>
  <moldb-formula>C13H15NO4</moldb-formula>
  <moldb-inchi>InChI=1S/C13H15NO4/c1-14-12(15)16-9-5-4-6-10-11(9)18-13(17-10)7-2-3-8-13/h4-6H,2-3,7-8H2,1H3,(H,14,15)</moldb-inchi>
  <moldb-inchikey>WWLOOFVJDXLDAS-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">249.100108</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM283646</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>Spiro[1,3-benzodioxole-2,1'-cyclopentane]-4-yl n-methylcarbamate</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organoheterocyclic compounds</superklass>
  <klass>Benzodioxoles</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0239530</sync-id>
  <structure-inchikey>WWLOOFVJDXLDAS-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>80000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000000000000020800000000100000040000000040000000000010000000000000000000000000000020000000000000100000000000801000048000000800000008480000080200000000000000000000000000000200200000000000000000000080000002000020000000000004000800000000000000000000000000000000002000000000000080000000040000202000000000000000000000000000040004080400400000000000020000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������h��������(�������(�������(������@(������@h�������@h�������@h�������@(������@(�������(������� ������(�������`�������`�������`�������`����������� ��(��� �� ��h���h���h��	h�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:01:00Z</structure-indexed-at>
</compound>
